SCHEMBL2853752

SCHEMBL2853752

CCCCc1cc(O)c(Oc2ccccc2)c(CCCC)c1O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.42
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
LTA4H P09960 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TYR P14679 1/20 0.40
ESR1 P03372 3/20 0.38
ESR2 Q92731 3/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2867962 0.89 HPGD (0.41) ALOX5HPGDMAPK1NPSR1NPC1
SCHEMBL2860947 0.89 PPARG (0.41) ALOX5HPGDMAPK1NPSR1LTA4H
SCHEMBL980196 0.83 LTA4H (0.42) ALOX5HPGDMAPK1NPSR1NPC1
SCHEMBL2863685 0.81 LTA4H (0.46) HPGDMAPK1NPSR1NPC1HTT
SCHEMBL980418 0.81 TYR (0.47) ALOX5HTTLTA4HTYR
SCHEMBL30355027 0.80 KDM4E (0.43) ALOX5HPGDMAPK1NPSR1KDM4E
SCHEMBL8022512 0.80 LTA4H (0.42) ALOX5HPGDMAPK1NPSR1NPC1
SCHEMBL2865307 0.80 KDM4E (0.46) HPGDMAPK1NPSR1LTA4HKDM4E
SCHEMBL980410 0.80 TYR (0.49) ALOX5HTTLTA4HTYR
SCHEMBL984506 0.80 TYR (0.49) ALOX5HTTLTA4HTYR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713449-B2 Polymer electrolytic material, polymer electrolytic part, membrane electrode assembly, and polymer electrolyte fuel cell TORAY INDUSTRIES, INC. (JP) 2010-05-11 US disclosed
US-20060180796-A1 Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell TORAY INDUSTRIES, INC. (JP) 2006-08-17 US disclosed
CN-1757130-A Polymer electrolyte material, polymer electrolyte part, film electrode composite element and polymer electrolyte fuel cells TORAY INDUSTRIES (JP) 2006-04-05 CN disclosed
EP-1619735-A1 POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE PART, MEMBRANE ELECTRODE COMPOSITE AND POLYMER ELECTROLYTE TYPE FUEL CELL TORAY INDUSTRIES, INC. (JP) 2006-01-25 EP disclosed